SCHEMBL7372162

SCHEMBL7372162

CCn1nc(-c2ccc(C)cc2)c2cccnc2c1=O

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.51
TBXAS1 P24557 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.50
ALDH1A1 P00352 2/20 0.47
MAPT P10636 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
PDE4A P27815 1/20 0.46
PDE4B Q07343 1/20 0.46
PDE4C Q08493 1/20 0.46
PDE4D Q08499 1/20 0.46
GAA P10253 1/20 0.46
TP53 P04637 1/20 0.45
COMT P21964 1/20 0.44
ATM Q13315 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7370600 0.90 MEN1 (0.51) RAB9AL3MBTL1ALDH1A1MAPTSMN1; SMN2
SCHEMBL7370618 0.90 RAB9A (0.51) RAB9ATBXAS1L3MBTL1ALDH1A1MAPT
SCHEMBL7365028 0.86 KDM4E (0.50) TBXAS1ALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL7370613 0.85 HPGD (0.52) RAB9ATBXAS1MAPTSMN1; SMN2PDE4A
SCHEMBL7366591 0.85 ALDH1A1 (0.59) RAB9AL3MBTL1ALDH1A1SMN1; SMN2MEN1
SCHEMBL7364065 0.84 PDE4A (0.57) RAB9AL3MBTL1ALDH1A1SMN1; SMN2PDE4A
SCHEMBL7361314 0.84 TBXAS1 (0.46) RAB9ATBXAS1SMN1; SMN2MEN1KMT2A
SCHEMBL7365662 0.82 HPGD (0.55) TBXAS1ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL7367402 0.82 NCOA1 (0.46) RAB9ATBXAS1ALDH1A1MAPTSMN1; SMN2
SCHEMBL7364120 0.80 TBXAS1 (0.50) RAB9ATBXAS1L3MBTL1ALDH1A1MAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0612321-A1 PYRIDO PYRIDAZINONE AND PYRIDAZINTHIONE COMPOUNDS WITH PDE IV INHIBITING ACTIVITY SYNTEX (U.S.A.) INC. (US) 1994-08-31 EP disclosed
WO-1993007146-A1 BENZO AND PYRIDO PYRIDAZINONE AND PYRIDAZINTHIONE COMPOUNDS WITH PDE IV INHIBITING ACTIVITY SYNTEX (U.S.A.) INC. (US) 1993-04-15 WO disclosed